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4-methyl-N-[1-[(3-nitrophenyl)carbamothioylamino]ethyl]benzamide

4-methyl-N-[1-[(3-nitrophenyl)carbamothioylamino]ethyl]benzamide

Systemtic Name:4-methyl-N-[1-[(3-nitrophenyl)carbamothioylamino]ethyl]benzamide
Openeye Name:4-methyl-N-[1-[(3-nitrophenyl)carbamothioylamino]ethyl]benzamide
CAS Name:4-methyl-N-[1-[[(3-nitroanilino)-sulfanylidenemethyl]amino]ethyl]benzamide
IUPAC Name:4-methyl-N-[1-[(3-nitrophenyl)carbamothioylamino]ethyl]benzamide
Traditional Name:4-methyl-N-[1-[(3-nitrophenyl)thiocarbamoylamino]ethyl]benzamide
Formula: C17H18N4O3S
MolecularWeight: 358.41482
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(C)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC(C)NC(=S)NC2=CC(=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C17H18N4O3S/c1-11-6-8-13(9-7-11)16(22)18-12(2)19-17(25)20-14-4-3-5-15(10-14)21(23)24/h3-10,12H,1-2H3,(H,18,22)(H2,19,20,25)


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